ethyl 6-chloranyl-2-methyl-1-oxidanylidene-4-phenylmethoxy-isoquinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-2-methyl-1-oxidanylidene-4-phenylmethoxy-isoquinoline-3-carboxylate Openeye Name: ethyl 4-benzyloxy-6-chloro-2-methyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 6-chloro-2-methyl-1-oxo-4-phenylmethoxy-3-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-2-methyl-1-oxo-4-phenylmethoxyisoquinoline-3-carboxylate Traditional Name: 4-benzoxy-6-chloro-1-keto-2-methyl-isoquinoline-3-carboxylic acid ethyl ester Formula: C20H18ClNO4 MolecularWeight: 371.81422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1C)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1C)OCC3=CC=CC=C3

InChI

InChI=1S/C20H18ClNO4/c1-3-25-20(24)17-18(26-12-13-7-5-4-6-8-13)16-11-14(21)9-10-15(16)19(23)22(17)2/h4-11H,3,12H2,1-2H3